N-(4-pyrimidin-2-yloxyphenyl)acetamide

C12H11N3O2 — CID 1487531

IUPACN-(4-pyrimidin-2-yloxyphenyl)acetamide
SMILESCC(=O)Nc1ccc(Oc2ncccn2)cc1
InChIInChI=1S/C12H11N3O2/c1-9(16)15-10-3-5-11(6-4-10)17-12-13-7-2-8-14-12/h2-8H,1H3,(H,15,16)
InChIKeyDXVKZDBYLFVMFB-UHFFFAOYSA-N
MW229.24 g/mol
LogP2.23
Rot. Bonds3

About N-(4-pyrimidin-2-yloxyphenyl)acetamide

N-(4-pyrimidin-2-yloxyphenyl)acetamide (PubChem CID 1487531) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-(4-pyrimidin-2-yloxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-pyrimidin-2-yloxyphenyl)acetamide
PubChem CID1487531
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-(4-pyrimidin-2-yloxyphenyl)acetamide
SMILESCC(=O)Nc1ccc(Oc2ncccn2)cc1
InChIInChI=1S/C12H11N3O2/c1-9(16)15-10-3-5-11(6-4-10)17-12-13-7-2-8-14-12/h2-8H,1H3,(H,15,16)
InChIKeyDXVKZDBYLFVMFB-UHFFFAOYSA-N
XLogP2.23
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-pyrimidin-2-yloxyphenyl)acetamide?
The IUPAC name of N-(4-pyrimidin-2-yloxyphenyl)acetamide (CID 1487531) is N-(4-pyrimidin-2-yloxyphenyl)acetamide.
What is the SMILES notation for N-(4-pyrimidin-2-yloxyphenyl)acetamide?
The canonical SMILES for N-(4-pyrimidin-2-yloxyphenyl)acetamide is CC(=O)Nc1ccc(Oc2ncccn2)cc1.
What is the InChIKey of N-(4-pyrimidin-2-yloxyphenyl)acetamide?
The InChIKey is DXVKZDBYLFVMFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-9(16)15-10-3-5-11(6-4-10)17-12-13-7-2-8-14-12/h2-8H,1H3,(H,15,16).
What are the key properties of N-(4-pyrimidin-2-yloxyphenyl)acetamide?
N-(4-pyrimidin-2-yloxyphenyl)acetamide has a molecular weight of 229.24 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrimidin-2-yloxyphenyl)acetamide is sourced from PubChem (CID 1487531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).